Cd(Ge3P4)2
Alexandria ALEXAlex-ID: agm003700151 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_65_spg148
CdGeP14 CdGeP2 GeP
2022-04-13 13:25:15.074201
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003700151).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm003700151
data_agm003700151
_cell_length_a 6.74230
_cell_length_b 6.74230
_cell_length_c 6.74230
_cell_angle_alpha 94.23740
_cell_angle_beta 94.23740
_cell_angle_gamma 94.23740
_cell_volume 303.85040
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Cd1 Cd 0.00000 0.00000 0.00000 1.00000
Ge1 Ge 0.66980 0.36688 0.82342 1.00000
Ge2 Ge 0.36688 0.82342 0.66980 1.00000
Ge3 Ge 0.82342 0.66980 0.36688 1.00000
Ge4 Ge 0.33020 0.63312 0.17658 1.00000
Ge5 Ge 0.63312 0.17658 0.33020 1.00000
Ge6 Ge 0.17658 0.33020 0.63312 1.00000
P1 P 0.69493 0.69493 0.69493 1.00000
P2 P 0.30507 0.30507 0.30507 1.00000
P3 P 0.63161 0.85400 0.14905 1.00000
P4 P 0.85400 0.14905 0.63161 1.00000
P5 P 0.14905 0.63161 0.85400 1.00000
P6 P 0.36839 0.14600 0.85095 1.00000
P7 P 0.14600 0.85095 0.36839 1.00000
P8 P 0.85095 0.36839 0.14600 1.00000
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